2-(3-nitropyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(3-nitropyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(3-nitropyrazol-1-yl)-N-[4-(1-piperidylmethyl)phenyl]acetamide CAS Name: 2-(3-nitro-1-pyrazolyl)-N-[4-(1-piperidinylmethyl)phenyl]acetamide IUPAC Name: 2-(3-nitropyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(3-nitropyrazol-1-yl)-N-[4-(piperidinomethyl)phenyl]acetamide Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)CN3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)CN3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O3/c23-17(13-21-11-8-16(19-21)22(24)25)18-15-6-4-14(5-7-15)12-20-9-2-1-3-10-20/h4-8,11H,1-3,9-10,12-13H2,(H,18,23)